methyl (Z)-2-(6-bromanyl-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)prop-2-enoate

Systemtic Name: methyl (Z)-2-(6-bromanyl-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)prop-2-enoate Openeye Name: methyl (Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)prop-2-enoate CAS Name: (Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)prop-2-enoate Traditional Name: (Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-3-(2-nitrophenyl)acrylic acid methyl ester Formula: C17H12BrNO6 MolecularWeight: 406.18428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

COC(=O)/C(=C\C1=CC=CC=C1[N+](=O)[O-])/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H12BrNO6/c1-23-17(20)12(6-10-4-2-3-5-14(10)19(21)22)11-7-15-16(8-13(11)18)25-9-24-15/h2-8H,9H2,1H3/b12-6-